Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KAT6A | Q92794 | 2/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.35 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.35 |
| ▸ | GSTP1 | P09211 | 1/20 | 0.35 |
| ▸ | ESR1 | P03372 | 1/20 | 0.35 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.35 |
| ▸ | GPR3 | P46089 | 2/20 | 0.35 |
| ▸ | KIF11 | P52732 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.34 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.34 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.34 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.33 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.33 |
| ▸ | ACP1 | P24666 | 1/20 | 0.33 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.33 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.33 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.33 |
| ▸ | PIM1 | P11309 | 1/20 | 0.33 |
| ▸ | PIM2 | Q9P1W9 | 1/20 | 0.33 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.33 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL8125229 | 0.84 | METAP2 (0.38) | GPR3KIF11ACP1IGF2BP2 | |
| SCHEMBL7685104 | 0.80 | GPR3 (0.39) | ESR2GPR3PTPN1HSD17B1HSD17B2 | |
| SCHEMBL7687621 | 0.80 | GPR3 (0.44) | GPR3KIF11SMN1; SMN2FFAR1FFAR4 | |
| SCHEMBL8089523 | 0.80 | CYP1A2 (0.53) | CYP1A2CYP2A6GSTP1ESR1ESR2 | |
| SCHEMBL6987825 | 0.79 | CYP1A2 (0.50) | CYP1A2CYP2A6GSTP1ESR1ESR2 | |
| SCHEMBL8128913 | 0.78 | DHODH (0.39) | GPR3ALOX5ALDH1A1MAPTFFAR1 | |
| SCHEMBL8634666 | 0.78 | ESR1 (0.37) | KAT6ACYP1A2CYP2A6GSTP1ESR1 | |
| SCHEMBL5320552 | 0.77 | PTPN5 (0.39) | SLC6A4ALDH1A1 | |
| SCHEMBL2448879 | 0.77 | ESR1 (0.48) | CYP1A2GSTP1ESR1ESR2SMN1; SMN2 | |
| SCHEMBL10448716 | 0.76 | CYP2A6 (0.50) | CYP1A2CYP2A6GSTP1ESR1ESR2 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0853764-A1 | COMBINATORIAL SYNTHESIS AND HIGH-THROUGHPUT SCREENING OF A REV-INHIBITING ARYLIDENEDIAMIDE ARRAY | ARQULE, INC. (US) | 1998-07-22 | — | — | EP | claimed |
| WO-1996035953-A1 | COMBINATORIAL SYNTHESIS AND HIGH-THROUGHPUT SCREENING OF A REV-INHIBITING ARYLIDENEDIAMIDE ARRAY | ARQULE, INC. (US) | 1996-11-14 | — | — | WO | claimed |
| EP-0853764-A1 | COMBINATORIAL SYNTHESIS AND HIGH-THROUGHPUT SCREENING OF A REV-INHIBITING ARYLIDENEDIAMIDE ARRAY | ARQULE, INC. (US) | 1998-07-22 | — | — | EP | disclosed |
| WO-1996035953-A1 | COMBINATORIAL SYNTHESIS AND HIGH-THROUGHPUT SCREENING OF A REV-INHIBITING ARYLIDENEDIAMIDE ARRAY | ARQULE, INC. (US) | 1996-11-14 | — | — | WO | disclosed |